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Succinic acid, 4-fluorophenethyl pentyl ester
SpectraBase Compound ID 1tnArMotE2C
InChI InChI=1S/C17H23FO4/c1-2-3-4-12-21-16(19)9-10-17(20)22-13-11-14-5-7-15(18)8-6-14/h5-8H,2-4,9-13H2,1H3
InChIKey ASZQJNMZWLUPHP-UHFFFAOYSA-N
Mol Weight 310.37 g/mol
Molecular Formula C17H23FO4
Exact Mass 310.158037 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5LaBMZGljOf
Name Succinic acid, 4-fluorophenethyl pentyl ester
Comments Computed using HOSE algorithm
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Exact Mass 310.158037380 u
Formula C17H23FO4
InChI InChI=1S/C17H23FO4/c1-2-3-4-12-21-16(19)9-10-17(20)22-13-11-14-5-7-15(18)8-6-14/h5-8H,2-4,9-13H2,1H3
InChIKey ASZQJNMZWLUPHP-UHFFFAOYSA-N
Molecular Weight 310.365 g/mol
SMILES C(CCC(OCCC1=CC=C(C=C1)F)=O)(OCCCCC)=O